(1R,5S)-8-benzyl-3,8-diazabicyclo[3.2.1]octane;dihydrochloride


Chemical Name: (1R,5S)-8-benzyl-3,8-diazabicyclo[3.2.1]octane;dihydrochloride
CAS Number: 93428-55-8
Product Number: AG00IHM2(AGN-PC-0HACOS)
Synonyms:
MDL No:
Molecular Formula: C13H20Cl2N2
Molecular Weight: 275.2173

Identification/Properties


Computed Properties
Molecular Weight:
275.217g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
274.1g/mol
Monoisotopic Mass:
274.1g/mol
Topological Polar Surface Area:
15.3A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
199
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



8-Benzyl-3,8-diazabicyclo[3.2.1]octane dihydrochloride, commonly known as $name$, serves as a valuable reagent in chemical synthesis due to its versatile applications. This compound is extensively utilized as a catalyst in various organic transformations, particularly in asymmetric synthesis. Its unique structural properties make it highly effective in promoting a wide range of reactions with excellent chemo-, regio-, and enantioselectivity.$name$ plays a crucial role in facilitating key transformations such as asymmetric Michael additions, aldol reactions, and acylation reactions. Its chiral nature enables the control of stereochemistry in the formation of complex molecular scaffolds, making it a valuable tool in the synthesis of pharmaceuticals, agrochemicals, and other biologically active compounds.In addition to its use in asymmetric catalysis, $name$ can also function as a Lewis base in aprotic solvents, enabling it to participate in various nucleophilic substitution and addition reactions. Its stability and reactivity profile make it a versatile reagent for the construction of C-C, C-N, and C-O bonds in complex organic molecules.Overall, 8-Benzyl-3,8-diazabicyclo[3.2.1]octane dihydrochloride, or $name$, stands as a pivotal agent in modern chemical synthesis, offering chemists a powerful tool for accessing structurally diverse and stereochemically complex compounds.